butyl 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(2-amino-2-oxo-ethyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(2-amino-2-oxoethyl)-4-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(2-amino-2-oxoethyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(2-amino-2-keto-ethyl)isonipecotoyl]amino]benzoic acid butyl ester Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)CC(=O)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)CC(=O)N

InChI

InChI=1S/C19H27N3O4/c1-2-3-12-26-19(25)15-4-6-16(7-5-15)21-18(24)14-8-10-22(11-9-14)13-17(20)23/h4-7,14H,2-3,8-13H2,1H3,(H2,20,23)(H,21,24)